In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2009 | 28 | Yes |
None
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.11 | 2.13 | -62.48 | 1 | 8 | -1 | 112 | 371.38 | 2 | ↓ |
Ref Reference (pH 7) | 1.93 | 4.84 | -60.12 | 1 | 8 | -1 | 109 | 371.38 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.66 | 4.01 | -19.44 | 2 | 8 | 0 | 109 | 372.388 | 2 | ↓ |
Lo Low (pH 4.5-6) | 1.47 | 6.66 | -20.81 | 2 | 8 | 0 | 106 | 372.388 | 2 | ↓ |